Information card for entry 7027758

Structure parameters

• Formula: C73 H82 N2 O4.5 P3 Pd3 S2
• Calculated formula: C73 H82 N2 O4.5 P3 Pd3 S2
• Title of publication: Reactivity of the palladium dimer [Pd2(μ-SO2)(μ-dba)(PBz3)2]. Syntheses and structural characterisation of [Pd3(μ-SO2)3(PBz3)3], [Pd2(μ-SO2)(μ-dppm)(PBz3)2], [Pd(SO2)(PBz3)2], [Pd3(μ-CO)2(μ-SO2)(PBz3)3] and [Pd3(μ-SO2)2(CNBut )2(PBz3)3] (Bz = benzyl) †
• Authors of publication: Arifhodzic-Radojevic, Sanja; Burrows, Andrew D.; Choi, Nick; McPartlin, Mary; Mingos, D. Michael P.; Tarlton, Stephen V.; Vilar, Ramón
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 22
• Pages of publication: 3981
• a: 22.985 ± 0.009 Å
• b: 24.213 ± 0.01 Å
• c: 26.926 ± 0.016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14985 ± 12 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.2803
• Residual factor for significantly intense reflections: 0.0821
• Weighted residual factors for all reflections: 0.2949
• Weighted residual factors for significantly intense reflections: 0.1798
• Goodness-of-fit parameter for all reflections: 0.921
• Goodness-of-fit parameter for significantly intense reflections: 1.24
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No